BDBM50286600 CHEMBL357757::Carbamoylmethyl-[2-({(2S,4S)-1-[(3-chloro-phenyl)-phenyl-carbamoyl]-4-dipentylcarbamoyl-piperidine-2-carbonyl}-amino)-ethyl]-carbamic acid benzyl ester

SMILES CCCCCN(CCCCC)C(=O)[C@H]1CCN([C@@H](C1)C(=O)NCCN(CC(N)=O)C(=O)OCc1ccccc1)C(=O)N(c1ccccc1)c1cccc(Cl)c1

InChI Key InChIKey=DGQXYBVOJPZERV-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50286600   

TargetSubstance-P receptor(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50286600(Carbamoylmethyl-[2-({(2S,4S)-1-[(3-chloro-phenyl)-...)
Affinity DataIC50: 1.80nMAssay Description:Inhibition of [125I]-substance P binding to human neurokinin-1 (hNK-1) receptor in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/20/2010
Entry Details Article